BAS 13321664
TL;DR: BAS 13321664 (CAS 879566-66-2) is a chemical compound with molecular formula C20H21N3O4S and molecular weight 399.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methyl-2-phenylsulfanylacetamide
Also Known As: BAS 13321664, N-((3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl)methyl)-N-methyl-2-(phenylthio)acetamide, N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methyl-2-phenylsulfanylacetamide, N-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-N-methyl-2-(phenylsulfanyl)acetamide
| Molecular Formula | C20H21N3O4S |
|---|---|
| Molecular Weight | 399.13 g/mol |
| LogP | 3.5045 |
| Topological Polar Surface Area | 77.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 399.12527 |
| Heavy Atoms | 28 |
| Complexity | 930.21 |
Chemical Identifiers
| CAS Number | 879566-66-2 |
|---|---|
| SMILES | CN(CC1=NC(=NO1)C2=CC(=C(C=C2)OC)OC)C(=O)CSC3=CC=CC=C3 |
Product Overview
BAS 13321664 (CAS 879566-66-2), with molecular formula C20H21N3O4S and molecular weight 399.13 g/mol. IUPAC: N-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methyl-2-phenylsulfanylacetamide.
Chemical Property Profile of BAS 13321664
Property Insights of BAS 13321664
The XLogP value of 3.5045 indicates that BAS 13321664 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.69 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 13321664. Following Lipinski's Rule of Five, BAS 13321664 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 13321664?
The CAS number of BAS 13321664 is 879566-66-2.
What is the molecular formula of BAS 13321664?
The molecular formula of BAS 13321664 is C20H21N3O4S.
What is the molecular weight of BAS 13321664?
The molecular weight of BAS 13321664 is 399.13 g/mol.
Where can I buy BAS 13321664?
You can request a quote for BAS 13321664 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 13321664?
Yes, KEHONG BIO provides custom synthesis services for BAS 13321664 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.